Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | SLC9A2 | Q9UBY0 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4138926 | 0.91 | KEAP1 (0.38) | KEAP1NFE2L2LMNASLC9A1SLC9A2 | |
| SCHEMBL3305431 | 0.87 | LMNA (0.34) | LMNANPC1RAB9AACHE | |
| SCHEMBL5254943 | 0.80 | NPC1 (0.38) | NPC1MAPK1RAB9A | |
| SCHEMBL4693843 | 0.80 | KEAP1 (0.40) | KEAP1NFE2L2LMNASLC9A1SLC9A2 | |
| SCHEMBL4695496 | 0.78 | KEAP1 (0.45) | KEAP1NFE2L2SLC9A1SLC9A2KMT2A | |
| Hydrochloric Acid SCHEMBL4145877 | 0.75 | HTT (0.39) | KEAP1NFE2L2LMNAKMT2AHTT | |
| SCHEMBL4697074 | 0.74 | NPC1 (0.34) | NPC1RAB9A | |
| SCHEMBL5187275 | 0.73 | GPR183 (0.39) | HPGDNPC1TSHRRAB9ATDP1 | |
| SCHEMBL4697059 | 0.71 | AGTR2 (0.32) | NPC1RAB9A | |
| SCHEMBL4147781 | 0.71 | KEAP1 (0.41) | KEAP1NFE2L2SLC9A1SLC9A2NPC1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1569935-B1 | HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREOF AND USE OF SAME AS MEDICAMENTS, SUCH AS ANTI-BACTERIAL MEDICAMENTS AND BETA-LACTAMASE INHIBITORS | NOVEXEL (FR) | 2008-08-20 | — | — | EP | disclosed |